N-[3-[[1,1-bis(oxidanylidene)-1,2-benzothiazol-3-yl]amino]propyl]-4-butoxy-benzamide

Systemtic Name: N-[3-[[1,1-bis(oxidanylidene)-1,2-benzothiazol-3-yl]amino]propyl]-4-butoxy-benzamide Openeye Name: 4-butoxy-N-[3-[(1,1-dioxo-1,2-benzothiazol-3-yl)amino]propyl]benzamide CAS Name: 4-butoxy-N-[3-[(1,1-dioxo-1,2-benzothiazol-3-yl)amino]propyl]benzamide IUPAC Name: 4-butoxy-N-[3-[(1,1-dioxo-1,2-benzothiazol-3-yl)amino]propyl]benzamide Traditional Name: 4-butoxy-N-[3-[(1,1-diketo-1,2-benzothiazol-3-yl)amino]propyl]benzamide Formula: C21H25N3O4S MolecularWeight: 415.5059

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=C(C=C1)C(=O)NCCCNC2=NS(=O)(=O)C3=CC=CC=C32

Isomeric SMILES

CCCCOC1=CC=C(C=C1)C(=O)NCCCNC2=NS(=O)(=O)C3=CC=CC=C32

InChI

InChI=1S/C21H25N3O4S/c1-2-3-15-28-17-11-9-16(10-12-17)21(25)23-14-6-13-22-20-18-7-4-5-8-19(18)29(26,27)24-20/h4-5,7-12H,2-3,6,13-15H2,1H3,(H,22,24)(H,23,25)